trimethyl-(2-prop-1-ynyl-1,3-dithian-2-yl)silane

C10H18S2Si — CID 11241712

IUPACtrimethyl-(2-prop-1-ynyl-1,3-dithian-2-yl)silane
SMILESCC#CC1([Si](C)(C)C)SCCCS1
InChIInChI=1S/C10H18S2Si/c1-5-7-10(13(2,3)4)11-8-6-9-12-10/h6,8-9H2,1-4H3
InChIKeyZGLGAXLYAWIVNM-UHFFFAOYSA-N
MW230.47 g/mol
LogP3.45
Rot. Bonds1

About trimethyl-(2-prop-1-ynyl-1,3-dithian-2-yl)silane

trimethyl-(2-prop-1-ynyl-1,3-dithian-2-yl)silane (PubChem CID 11241712) has the molecular formula C10H18S2Si and a molecular weight of 230.47 g/mol. Its IUPAC name is trimethyl-(2-prop-1-ynyl-1,3-dithian-2-yl)silane.

Molecular Properties

Compound Nametrimethyl-(2-prop-1-ynyl-1,3-dithian-2-yl)silane
PubChem CID11241712
Molecular FormulaC10H18S2Si
Molecular Weight230.47 g/mol
Exact Mass230.06
IUPAC Nametrimethyl-(2-prop-1-ynyl-1,3-dithian-2-yl)silane
SMILESCC#CC1([Si](C)(C)C)SCCCS1
InChIInChI=1S/C10H18S2Si/c1-5-7-10(13(2,3)4)11-8-6-9-12-10/h6,8-9H2,1-4H3
InChIKeyZGLGAXLYAWIVNM-UHFFFAOYSA-N
XLogP3.45
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.47
LogP ≤ 53.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

2-(Triisopropylsilyl)-1,3-dithiane
CID 4598885
2-(tert-Butyldimethylsilyl)-1,3-dithiane
CID 552599
2-Methyl-2-(trimethylsilyl)-1,3-dithiane
CID 12521349
1,3-Dithian-2-yl(triethyl)silane
CID 11230069
Silane, trimethyl[2-(1-methylethyl)-1,3-dithian-2-yl]-
CID 4144283
(2-tert-Butyl-1,3-dithian-2-yl)(trimethyl)silane
CID 315853
[2-(1,3-Dithian-2-ylmethyl)-1,3-dithian-2-yl]-trimethylsilane
CID 5246606
Silane, trimethyl(2-pentyl-1,3-dithian-2-yl)-
CID 11323002
Tert-butyl-(2-hex-1-ynyl-1,3-dithian-2-yl)-dimethylsilane
CID 11347577
Tert-butyl-dimethyl-(2-prop-1-ynyl-1,3-dithian-2-yl)silane
CID 11380278
2-(Trimethylsilylethynyl)-1,3-dithiane
CID 11424482
Trimethyl-[2-(2-methyl-1,3-dithian-2-yl)ethynyl]silane
CID 11447575

Frequently Asked Questions

What is the IUPAC name of trimethyl-(2-prop-1-ynyl-1,3-dithian-2-yl)silane?
The IUPAC name of trimethyl-(2-prop-1-ynyl-1,3-dithian-2-yl)silane (CID 11241712) is trimethyl-(2-prop-1-ynyl-1,3-dithian-2-yl)silane.
What is the SMILES notation for trimethyl-(2-prop-1-ynyl-1,3-dithian-2-yl)silane?
The canonical SMILES for trimethyl-(2-prop-1-ynyl-1,3-dithian-2-yl)silane is CC#CC1([Si](C)(C)C)SCCCS1.
What is the InChIKey of trimethyl-(2-prop-1-ynyl-1,3-dithian-2-yl)silane?
The InChIKey is ZGLGAXLYAWIVNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18S2Si/c1-5-7-10(13(2,3)4)11-8-6-9-12-10/h6,8-9H2,1-4H3.
What are the key properties of trimethyl-(2-prop-1-ynyl-1,3-dithian-2-yl)silane?
trimethyl-(2-prop-1-ynyl-1,3-dithian-2-yl)silane has a molecular weight of 230.47 g/mol, XLogP of 3.45, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-(2-prop-1-ynyl-1,3-dithian-2-yl)silane is sourced from PubChem (CID 11241712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).